%chk=000265612.chk
%nprocshared=4
%mem=3GB
#p opt=(loose,noeigentest) PBEPBE/SDD pop=(full, Hirshfeld, NPA) GFInput nosymm

000265612

0 1
O -3.444847 -2.585456 -0.518719
O -5.617961 1.479813 -0.835459
N -1.022310 -1.005829 0.601314
N -1.127312 1.269777 0.843062
N -3.469395 1.536387 -0.013354
N -4.532056 -0.559032 -0.676910
C 2.073093 0.130485 0.381231
C 3.507236 0.129079 0.924052
C 1.047057 0.163021 1.525189
C 4.533285 0.099639 -0.216880
C -0.344764 0.142825 0.999950
C 5.969987 0.096134 0.322549
C -2.299024 -0.603526 0.166363
C -2.330689 0.809953 0.329058
C 6.995856 0.065965 -0.818177
C -3.398457 -1.380985 -0.349082
C 8.434011 0.062714 -0.280844
C -0.554969 -2.393184 0.617337
C -4.615940 0.859814 -0.532205
C -3.496107 3.008849 0.159963
C 9.459106 0.032884 -1.412204
C -5.750872 -1.218824 -1.222052
H 1.916754 1.010011 -0.277707
H 1.907035 -0.757110 -0.258526
H 3.673529 1.025628 1.553526
H 3.662129 -0.740638 1.591206
H 1.214171 -0.679999 2.227341
H 1.190162 1.090381 2.130345
H 4.368421 -0.791837 -0.852263
H 4.383982 0.973770 -0.880649
H 6.137366 0.989952 0.954396
H 6.121741 -0.775764 0.987607
H 6.847226 0.938053 -1.483810
H 6.831226 -0.826231 -1.452353
H 8.601774 0.956740 0.351267
H 8.585995 -0.810184 0.383773
H 0.364417 -2.509735 0.016375
H -0.353374 -2.731982 1.649359
H -1.332126 -3.068323 0.187118
H -4.473234 3.413467 -0.166507
H -2.694590 3.477564 -0.438572
H -3.334932 3.270777 1.220968
H 9.361476 0.904840 -2.069019
H 10.482194 0.031705 -1.019649
H 9.346581 -0.860896 -2.036338
H -5.587316 -2.310616 -1.295471
H -5.985677 -0.823325 -2.225373
H -6.616858 -1.029550 -0.564426


%chk=000265612-Freq.chk
%nprocshared=4
%mem=3GB
#p freq=noraman PBEPBE/SDD

000265612

0 1
O -3.582603 -2.644788 -0.519843
O -5.663262 1.577279 -0.833332
N -1.110686 -1.080091 0.600719
N -1.162988 1.192573 0.836288
N -3.467980 1.522684 -0.003692
N -4.599872 -0.506133 -0.665440
C 2.055236 0.082284 0.346106
C 3.500873 0.138095 0.886654
C 1.000364 0.045268 1.490760
C 4.565753 0.090554 -0.232008
C -0.413730 0.059190 0.994700
C 6.013652 0.184384 0.300617
C -2.378305 -0.652945 0.166427
C -2.369234 0.742102 0.325085
C 7.082036 0.075978 -0.810515
C -3.505319 -1.385224 -0.345893
C 8.529859 0.182303 -0.279055
C -0.646762 -2.478477 0.648782
C -4.635496 0.911828 -0.517677
C -3.427781 2.985783 0.181450
C 9.591705 0.053427 -1.392479
C -5.836113 -1.114436 -1.208780
H 1.857096 0.965632 -0.291030
H 1.938284 -0.809303 -0.303292
H 3.632627 1.064992 1.482409
H 3.668154 -0.708513 1.585598
H 1.179503 -0.847218 2.121764
H 1.133707 0.934691 2.131422
H 4.448770 -0.851108 -0.808378
H 4.384636 0.918027 -0.949160
H 6.143628 1.144417 0.842623
H 6.181935 -0.619341 1.048200
H 6.911073 0.871540 -1.565919
H 6.959471 -0.889800 -1.344384
H 8.655411 1.152406 0.243963
H 8.695670 -0.605399 0.484339
H 0.270149 -2.602855 0.048093
H -0.442343 -2.783460 1.690116
H -1.444434 -3.115057 0.235433
H -4.401911 3.387486 -0.132904
H -2.619412 3.422550 -0.428603
H -3.238172 3.227184 1.240727
H 9.468214 0.848070 -2.152567
H 10.617110 0.131127 -0.986508
H 9.505907 -0.920674 -1.910240
H -5.668510 -2.199784 -1.265847
H -6.052701 -0.702347 -2.207889
H -6.690212 -0.887697 -0.550044


